2-[[5-(1-hydroxyethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-butanamide

Systemtic Name: 2-[[5-(1-hydroxyethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-butanamide Openeye Name: 2-[[5-(1-hydroxyethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-butanamide CAS Name: 2-[[5-(1-hydroxyethyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-phenylbutanamide IUPAC Name: 2-[[5-(1-hydroxyethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylbutanamide Traditional Name: 2-[[5-(1-hydroxyethyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-phenyl-butyramide Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2C)C(C)O

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2C)C(C)O

InChI

InChI=1S/C15H20N4O2S/c1-4-12(14(21)16-11-8-6-5-7-9-11)22-15-18-17-13(10(2)20)19(15)3/h5-10,12,20H,4H2,1-3H3,(H,16,21)